AB75477
80845-58-5 | Methyl 1-benzyl-1,2,3,6-tetrahydropyridine-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB75477
ChemicalName
Methyl 1-benzyl-1,2,3,6-tetrahydropyridine-4-carboxylate
CasNumber
80845-58-5
MolecularFormula
C14H17NO2
MolecularWeight
231.2903
MdlNumber
MFCD18651701
Smiles
COC(=O)C1=CCN(CC1)Cc1ccccc1
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
2
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CatalogNumber: AB75477
ChemicalName: Methyl 1-benzyl-1,2,3,6-tetrahydropyridine-4-carboxylate
CasNumber: 80845-58-5
MolecularFormula: C14H17NO2
MolecularWeight: 231.2903
MdlNumber: MFCD18651701
Smiles: COC(=O)C1=CCN(CC1)Cc1ccccc1
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 2
CatalogNumber:
AB75477
ChemicalName:
Methyl 1-benzyl-1,2,3,6-tetrahydropyridine-4-carboxylate
CasNumber:
80845-58-5
MolecularFormula:
C14H17NO2
MolecularWeight:
231.2903
MdlNumber:
MFCD18651701
Smiles:
COC(=O)C1=CCN(CC1)Cc1ccccc1
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
2
CatalogNumber: AB75478
ChemicalName: Methyl 1-benzyl-5-bromopyrazole-3-carboxylate
CasNumber: 1434128-50-3
MolecularFormula: C12H11BrN2O2
MolecularWeight: 295.1319
MdlNumber: MFCD24842550
Smiles: COC(=O)c1nn(c(c1)Br)Cc1ccccc1
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3
CatalogNumber:
AB75478
ChemicalName:
Methyl 1-benzyl-5-bromopyrazole-3-carboxylate
CasNumber:
1434128-50-3
MolecularFormula:
C12H11BrN2O2
MolecularWeight:
295.1319
MdlNumber:
MFCD24842550
Smiles:
COC(=O)c1nn(c(c1)Br)Cc1ccccc1
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3
CatalogNumber: AB75479
ChemicalName: Methyl 1-benzylpiperidine-4-carboxylate
CasNumber: 10315-06-7
MolecularFormula: C14H19NO2
MolecularWeight: 233.3062
MdlNumber: MFCD09750949
Smiles: COC(=O)C1CCN(CC1)Cc1ccccc1
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 2.1
CatalogNumber:
AB75479
ChemicalName:
Methyl 1-benzylpiperidine-4-carboxylate
CasNumber:
10315-06-7
MolecularFormula:
C14H19NO2
MolecularWeight:
233.3062
MdlNumber:
MFCD09750949
Smiles:
COC(=O)C1CCN(CC1)Cc1ccccc1
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
2.1
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Smiles: COC(=O)C1(F)CCCN(C1)C(=O)OC(C)(C)C
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Smiles:
COC(=O)C1(F)CCCN(C1)C(=O)OC(C)(C)C
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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